PDBx/mmCIF
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Category Group
chem_shift_isotope_effect
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chem_shift_isotope_effect
Categories that capture chemical shift isotope effect values and links to the samples, sample conditions, NMR experiments, and other information about how the values were derived.
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chem_shift_isotope_effect_list
isotope_effect
isotope_effect_experiment
isotope_effect_software
isotope_label_pattern
